Methyl 3-hydroxydecanoate - ≥98% , CAS No.62675-82-5

CAS: 62675-82-5 Cat. No.: M274751 분자식: C₁₁H₂₂O₃ 분자량: 202.29

GRADE & PURITY ≥98%

Synonyms

SB50162 | Methyl ester of 3-hydroxydecanoic acid | 3-hydroxy Decanoic Acid methyl ester | FT-0669510 | r-(3)-Hydroxydecanoic acid,methyl ester | Methyl 3-hydroxydecanoate # | DL-2-HYDROXYDECANOICACIDMETHYLESTER | FT-0695823 | PD077431 | rac 3-Hydroxydecan

Storage

Store at -20°C,Argon charged,Desiccated

Shipped In

Ice chest + Ice pads

Application

Drug Delivery, Surface Modification, PEGylation of Protein, Peptide & Oligo

Specifications

동의어

SB50162 | Methyl ester of 3-hydroxydecanoic acid | 3-hydroxy Decanoic Acid methyl ester | FT-0669510 | r-(3)-Hydroxydecanoic acid,methyl ester | Methyl 3-hydroxydecanoate # | DL-2-HYDROXYDECANOICACIDMETHYLESTER | FT-0695823 | PD077431 | rac 3-Hydroxydecan

사양 및 순도

≥98%

생화학 및 생리적 메커니즘

3-Hydroxy fatty acid methyl ester. For use as standard and possible use in biological systems.

보관 조건

Store at -20°C,Argon charged,Desiccated

배송

Ice chest + Ice pads

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순수함

≥98%

이름과 식별자

• 정식 스마일: CCCCCCCC(CC(=O)OC)O
• IUPAC Name: methyl 3-hydroxydecanoate
• InChIKey: UBVACUZVNTVHTE-UHFFFAOYSA-N
• INCHI: 1S/C11H22O3/c1-3-4-5-6-7-8-10(12)9-11(13)14-2/h10,12H,3-9H2,1-2H3
• 이성체 SMILES: CCCCCCCC(CC(=O)OC)O
• 분자량: 202.29
• Reaxy-Rn: 1770390
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1770390&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Lipids and lipid-like molecules
    • 분류 Fatty Acyls
      • Subclass Fatty alcohols

• Kingdom: Organic compounds
• Superclass: Lipids and lipid-like molecules
• 분류: Fatty Acyls
• Subclass: Fatty alcohols
• Intermediate Tree Nodes: Not available
• Direct Parent: Fatty alcohols
• Alternative Parents: Fatty acid methyl esters Beta hydroxy acids and derivatives Methyl esters Secondary alcohols Monocarboxylic acids and derivatives Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Fatty alcohol - Beta-hydroxy acid - Fatty acid ester - Fatty acid methyl ester - Hydroxy acid - Methyl ester - Carboxylic acid ester - Secondary alcohol - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Organooxygen compound - Alcohol - Hydrocarbon derivative - Organic oxide - Carbonyl group - Organic oxygen compound - Aliphatic acyclic compound
• 설명: This compound belongs to the class of organic compounds known as fatty alcohols. These are aliphatic alcohols consisting of a chain of a least six carbon atoms.
• External Descriptors: Not available

Data sources

1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.

DOI: 10.1186/s13321-016-0174-y

화학 및 물리적 특성

• 용해성: Soluble in ethanol
• 분자량: 202.290 g/mol
• XLogP3: 2.800
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 9
• Exact Mass: 202.157 Da
• Monoisotopic Mass: 202.157 Da
• Topological Polar Surface Area: 46.500 Ų
• Heavy Atom Count: 14
• Formal Charge: 0
• Complexity: 145.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 1
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1

참고 문헌

1. Weiqiang Wang, Weifeng Zhang, Fengjiao Chu, Tingting Xiao, Dongdong Hu, Pengyi Tang, Jiajia Gao, Honghua Ge.  (2025)  An engineered living biofilm system for sustainable conversion of CO2 into polyhydroxyalkanoates.  Cell Reports Physical Science,      [PMID:] [10.1016/j.xcrp.2025.102676]